Brightway Flows 1.0
GitHub

3-aminopropan-1-ol

fo-db5592f76f80154a

Identity

Type
Neutral molecule
CAS
156-87-6
EC
205-864-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 3-aminopropan-1-ol

Alternative labels

19

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string WUGQZFFCHPXWKQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H9NO/c4-2-1-3-5/h5H,1-4H2
IUPAC name chemrof:IUPAC_name 3-aminopropan-1-ol
Molecular formula chemrof:molecular_formula C3H9NO
Molecular mass chemrof:molecular_mass 75.111
Monoisotopic mass chemrof:monoisotopic_mass 75.06841, 75.068414
SMILES string chemrof:smiles_string NCCCO

Known URLs

22

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=156-87-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:143408 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.005.333 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0059746 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7766 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL115530 enrich_references.pubchem_identifier_url
foodb.food foodb.food:FDB006242 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/YMA7C44XGY enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0140038 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.560G enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:0D8 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/9086 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2735 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/10845535 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18641449 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/20223073 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24001040 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28796947 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/31421187 enrich_references.chebi_xrefs
reaxys reaxys:741855 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q223042 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/3-Amino-1-propanol enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
ab3ef9c2-d87c-4186-b2db-195a54432843 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
b42676f5-14b7-4f16-ae4c-1b9e7a546d46 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
c519ba82-7341-47a0-98d2-5de26d79e73b Environmental → Air → Indoor EF 3.1 kg 2
a1acc27b-857a-4824-9037-651f9c1e3ec5 Environmental → Air → Long-term EF 3.1 kg 0
f13b480f-e8c6-4135-862a-1614ce0c6179 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
9d296a39-8921-4bcb-8ac9-9fcd84cb804c Environmental → Air → Unknown EF 3.1 kg 2
55d6fc7b-679b-4f26-94a1-75c2c2ed84ad Environmental → Ground → Agricultural EF 3.1 kg 2
1aef2bea-864b-41ed-a2d1-6b4655833fc2 Environmental → Ground → Non-agricultural EF 3.1 kg 2
18fdb3d6-aef1-4c6d-bfc6-609c8f0f1b10 Environmental → Ground → Unknown EF 3.1 kg 2
05c1f17d-de9f-4e4e-baf5-7e581c81a7dd Environmental → Water → Long-term EF 3.1 kg 0
d426a176-1090-40e1-980d-c89ce998da70 Environmental → Water → Ocean EF 3.1 kg 2
25b7a61a-229d-48b4-a284-41a5690d5fc9 Environmental → Water → Surface water EF 3.1 kg 2
0897879c-7164-420d-abaa-0ba9e330cce9 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-db5592f76f80154a",
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  "altLabel": [
    {
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    },
    {
      "@value": "1-amino-3-hydroxypropane",
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    },
    {
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    },
    {
      "@value": "1-Propanol, 3-amino-",
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    },
    {
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    },
    {
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    {
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